(4-octylphenyl) 2,3-bis(fluoranyl)-4-hexoxy-benzoate

Systemtic Name: (4-octylphenyl) 2,3-bis(fluoranyl)-4-hexoxy-benzoate Openeye Name: (4-octylphenyl) 2,3-difluoro-4-hexoxy-benzoate CAS Name: 2,3-difluoro-4-hexoxybenzoic acid (4-octylphenyl) ester IUPAC Name: (4-octylphenyl) 2,3-difluoro-4-hexoxybenzoate Traditional Name: 2,3-difluoro-4-hexoxy-benzoic acid (4-octylphenyl) ester Formula: C27H36F2O3 MolecularWeight: 446.569746

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CC=C(C=C1)OC(=O)C2=C(C(=C(C=C2)OCCCCCC)F)F

Isomeric SMILES

CCCCCCCCC1=CC=C(C=C1)OC(=O)C2=C(C(=C(C=C2)OCCCCCC)F)F

InChI

InChI=1S/C27H36F2O3/c1-3-5-7-9-10-11-13-21-14-16-22(17-15-21)32-27(30)23-18-19-24(26(29)25(23)28)31-20-12-8-6-4-2/h14-19H,3-13,20H2,1-2H3